3-methyl-5-[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]thiophene-2,4-dicarboxylic acid

Systemtic Name: 3-methyl-5-[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]thiophene-2,4-dicarboxylic acid Openeye Name: 5-[(4-hydroxy-4-oxo-butanoyl)amino]-3-methyl-thiophene-2,4-dicarboxylic acid CAS Name: 5-[(4-hydroxy-1,4-dioxobutyl)amino]-3-methylthiophene-2,4-dicarboxylic acid IUPAC Name: 5-[(4-hydroxy-4-oxobutanoyl)amino]-3-methylthiophene-2,4-dicarboxylic acid Traditional Name: 5-[(4-hydroxy-4-keto-butanoyl)amino]-3-methyl-thiophene-2,4-dicarboxylic acid Formula: C11H11NO7S MolecularWeight: 301.27254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)O)NC(=O)CCC(=O)O)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1C(=O)O)NC(=O)CCC(=O)O)C(=O)O

InChI

InChI=1S/C11H11NO7S/c1-4-7(10(16)17)9(20-8(4)11(18)19)12-5(13)2-3-6(14)15/h2-3H2,1H3,(H,12,13)(H,14,15)(H,16,17)(H,18,19)